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Peer-reviewedCC BYActa crystallographica. Section E, Crystallographic communications

Crystal structure and Hirshfeld surface analysis of phenyl-alanine hydro-bromide.

5 affiliations
  1. 1Department of Chemistry, Taras Shevchenko National University of Kyiv, Volodymyrska St. 64, Kyiv 01601, Ukraine.
  2. 2Department of Inorganic Polymers, Petru Poni Institute of Macromolecular Chemistry, Aleea Grigore Ghica Voda 41-A, Iasi 700487, Romania.
  3. 3Department of General and Inorganic Chemistry, National Technical University of Ukraine Igor Sikorsky Kyiv Polytechnic Institute, Beresteiskyi Pr. 37, Kyiv 03056, Ukraine.
  4. 4Bakul Institute for Superhard Materials, National Academy of Sciences of Ukraine, Avtozavodska St. 2, Kyiv 04074, Ukraine.
  5. 5Institute of Innovative Education of Kyiv National University of Construction and Architecture, 4 Osvity Street, Kyiv 03037, Ukraine.

Abstract

Amino acid salts represent a diverse class of mol-ecular solids in which ionic inter-actions and hy-dro-gen bonding between protonated amino acid species and counter-ions govern the formation of supra-molecular architectures. Phenyl-alanine hydro-bromide (systematic name: 1-carb-oxy-2-phenyl-ethan-1-aminium bromide, C9H12NO2+·Br-) crystallizes in the chiral ortho-rhom-bic space group P212121. Its structure is built from protonated phenyl-alaninium cations, which inter-act with bromide anions through a network of N-H⋯Br and O-H⋯Br hy-dro-gen bonds, forming bilayers propagating parallel to the ab plane, with the polar groups oriented toward the inter-ior of the bilayers. The crystal structure is additionally consolidated by three types of weak T-shaped C(sp2)-H⋯π inter-actions.

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BibTeX
@article{kucheriv2026crystal,
  title = {{Crystal structure and Hirshfeld surface analysis of phenyl-alanine hydro-bromide.}},
  author = {Olesia I Kucheriv and Alexandra Bargan and Vadim Potaskalov and Oleksii Brusylovets and Olena Prysiazhna},
  journal = {Acta crystallographica. Section E, Crystallographic communications},
  year = {2026},
  month = oct,
  doi = {10.1107/s2056989026010406},
  url = {https://europepmc.org/article/MED/42997410},
  note = {CC BY},
}
RIS
TY  - JOUR
TI  - Crystal structure and Hirshfeld surface analysis of phenyl-alanine hydro-bromide.
AU  - Olesia I Kucheriv
AU  - Alexandra Bargan
AU  - Vadim Potaskalov
AU  - Oleksii Brusylovets
AU  - Olena Prysiazhna
PY  - 2026
DA  - 2026/10/20
JO  - Acta crystallographica. Section E, Crystallographic communications
DO  - 10.1107/s2056989026010406
UR  - https://europepmc.org/article/MED/42997410
AB  - Amino acid salts represent a diverse class of mol-ecular solids in which ionic inter-actions and hy-dro-gen bonding between protonated amino acid species and counter-ions govern the formation of supra-molecular architectures. Phenyl-alanine hydro-bromide (systematic name: 1-carb-oxy-2-phenyl-ethan-1-aminium bromide, C9H12NO2+·Br-) crystallizes in the chiral ortho-rhom-bic space group P212121. Its structure is built from protonated phenyl-alaninium cations, which inter-act with bromide anions through a network of N-H⋯Br and O-H⋯Br hy-dro-gen bonds, forming bilayers propagating parallel to the ab plane, with the polar groups oriented toward the inter-ior of the bilayers. The crystal structure is additionally consolidated by three types of weak T-shaped C(sp2)-H⋯π inter-actions.
SN  - 2056-9890
ER  -